%chk=000180525.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180525

0 1
O 4.234092 1.932958 1.084359
O 4.233512 1.934610 -1.084924
O 4.604366 -1.310211 -1.084689
O 4.604072 -1.311897 1.085114
O -6.521066 -0.177597 0.000066
O -5.667049 1.811861 -0.000531
N 3.713291 1.774562 -0.000267
N 4.062269 -1.272113 0.000171
N -5.579377 0.596203 -0.000242
C 0.442198 -0.142615 -0.000115
C -0.508768 0.946024 -0.000159
C -0.237161 -1.416745 -0.000111
C -1.847139 0.323551 -0.000174
C -1.684549 -1.113485 -0.000150
C 1.835388 0.017269 -0.000089
C -0.048751 2.233681 -0.000189
C 0.500794 -2.567993 -0.000076
C 2.264718 1.388470 -0.000177
C 2.562671 -1.222052 0.000013
C -3.105036 0.888761 -0.000206
C -2.783080 -1.952509 -0.000158
C 1.365642 2.438215 -0.000211
C 1.925201 -2.448069 0.000001
C -4.215198 0.010713 -0.000211
C -4.069369 -1.377547 -0.000185
H -0.714390 3.096934 -0.000217
H 0.047302 -3.558916 -0.000085
H -3.263072 1.972567 -0.000234
H -2.670643 -3.036983 -0.000142
H 1.726536 3.474151 -0.000285
H 2.510986 -3.375348 0.000083
H -4.959888 -2.019749 -0.000179


%chk=000180525-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180525

0 1
O 4.337840 1.080912 1.123052
O 4.151949 2.850237 -0.309880
O 4.495306 -0.472663 -1.170229
O 4.735866 -2.213125 0.290280
O -6.603519 -0.216830 -0.029975
O -5.703874 1.871551 -0.217814
N 3.694885 1.790604 0.257632
N 4.043463 -1.294423 -0.283953
N -5.598865 0.589951 -0.097414
C 0.445067 -0.142535 0.008598
C -0.502207 0.931170 -0.091467
C -0.233532 -1.403378 0.117652
C -1.847527 0.315717 -0.045809
C -1.683013 -1.112485 0.086873
C 1.857499 0.019405 0.000559
C -0.030650 2.239795 -0.213396
C 0.523596 -2.572232 0.232498
C 2.291826 1.394491 -0.024390
C 2.590293 -1.222492 0.016719
C -3.124844 0.888512 -0.109772
C -2.804814 -1.958926 0.161565
C 1.380777 2.453890 -0.162461
C 1.945246 -2.461252 0.164665
C -4.232914 0.009630 -0.034207
C -4.097839 -1.391260 0.099946
H -0.701507 3.098071 -0.312501
H 0.066015 -3.560053 0.339011
H -3.298579 1.962680 -0.210997
H -2.691883 -3.042563 0.262721
H 1.784250 3.470062 -0.197955
H 2.569630 -3.359006 0.194864
H -4.999442 -2.006752 0.151388


